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N-Fluoropyridinium trichloromethansulphonate
SpectraBase Compound ID 5EEqBBmRhcq
InChI InChI=1S/C5H5FN.CHCl3O3S/c6-7-4-2-1-3-5-7;2-1(3,4)8(5,6)7/h1-5H;(H,5,6,7)/q+1;/p-1
InChIKey ICZDGJRHMQJBSJ-UHFFFAOYSA-M
Mol Weight 296.53 g/mol
Molecular Formula C6H5Cl3FNO3S
Exact Mass 294.903975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YpHQKBlBVI
Name N-Fluoropyridinium trichloromethansulphonate
Comments Computed using HOSE algorithm
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Exact Mass 294.903975459 u
Formula C6H5Cl3FNO3S
InChI InChI=1S/C5H5FN.CHCl3O3S/c6-7-4-2-1-3-5-7;2-1(3,4)8(5,6)7/h1-5H;(H,5,6,7)/q+1;/p-1
InChIKey ICZDGJRHMQJBSJ-UHFFFAOYSA-M
Molecular Weight 296.527 g/mol
SMILES C(S(=O)(=O)[O-])(Cl)(Cl)Cl.c1[n+](cccc1)F